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Home > Encyclopedia > 2-benzyl-5-nitroisoquinolin-2-ium

2-benzyl-5-nitroisoquinolin-2-ium

2-benzyl-5-nitroisoquinolin-2-ium structure

2-benzyl-5-nitroisoquinolin-2-ium 

structure
  • CAS No:

    52166-52-6

  • Formula:

    C16H13N2O2+

  • Chemical Name:

    2-benzyl-5-nitroisoquinolin-2-ium

  • Synonyms:

    2-benzyl-5-nitroisoquinolin-2-ium;Isoquinolinium, 5-nitro-2-(phenylmethyl)-;2-Benzyl-5-nitroisoquinolinium;SCHEMBL13773330;DTXSID90330666;ZINC1566248;52166-52-6

2-benzyl-5-nitroisoquinolin-2-ium Basic Attributes

265.29 g/mol

265.097702662 g/mol

DTXSID90330666

Characteristics

49.7 Ų

Computed Properties

Molecular Weight:265.29
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:265.097702662
Monoisotopic Mass:265.097702662
Topological Polar Surface Area:49.7
Heavy Atom Count:20
Formal Charge:1
Complexity:336
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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